methyl 1-[2,2-bis(propan-2-ylsulfonyl)ethyl]-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate

Systemtic Name: methyl 1-[2,2-bis(propan-2-ylsulfonyl)ethyl]-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate Openeye Name: methyl 1-[2,2-bis(isopropylsulfonyl)ethyl]-3-[(isopropylsulfonylamino)methyl]indole-5-carboxylate CAS Name: 1-[2,2-bis(propan-2-ylsulfonyl)ethyl]-3-[(propan-2-ylsulfonylamino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2,2-bis(propan-2-ylsulfonyl)ethyl]-3-[(propan-2-ylsulfonylamino)methyl]indole-5-carboxylate Traditional Name: 1-[2,2-bis(isopropylsulfonyl)ethyl]-3-[(isopropylsulfonylamino)methyl]indole-5-carboxylic acid methyl ester Formula: C22H34N2O8S3 MolecularWeight: 550.70896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNS(=O)(=O)C(C)C)S(=O)(=O)C(C)C

Isomeric SMILES

CC(C)S(=O)(=O)C(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNS(=O)(=O)C(C)C)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H34N2O8S3/c1-14(2)33(26,27)21(34(28,29)15(3)4)13-24-12-18(11-23-35(30,31)16(5)6)19-10-17(22(25)32-7)8-9-20(19)24/h8-10,12,14-16,21,23H,11,13H2,1-7H3